ethyl 3-oxidanylidene-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(pyridin-3-ylmethyl)amino]propanoate

Systemtic Name: ethyl 3-oxidanylidene-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(pyridin-3-ylmethyl)amino]propanoate Openeye Name: ethyl 3-oxo-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(3-pyridylmethyl)amino]propanoate CAS Name: 3-oxo-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(3-pyridinylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(pyridin-3-ylmethyl)amino]propanoate Traditional Name: 3-keto-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-(3-pyridylmethyl)amino]propionic acid ethyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N(CC1=CN=CC=C1)CC2=C(NN=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(=O)N(CC1=CN=CC=C1)CC2=C(NN=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3/c1-2-28-20(27)11-19(26)25(14-16-7-6-10-22-12-16)15-18-13-23-24-21(18)17-8-4-3-5-9-17/h3-10,12-13H,2,11,14-15H2,1H3,(H,23,24)